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Compound Detail

CHEMBL1789753

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O=C(O)C[C@H](O)C[C@H](O)CCn1c(-c2ccc(F)cc2)nc(C(=O)NCc2ccc(F)cc2F)c1C1CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1789753
Phase Preclinical
Structure Type MOL
InChI Key ALMIEUFUHIWSJC-NHCUHLMSSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

531.5
MW (Da)
3.75
ALogP
6
HBA
4
HBD
124.7
PSA (Ų)
0.28
QED
1
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H28F3N3O5
MW 531.53
Aromatic Rings 3
Heavy Atoms 38
NP-Likeness -0.82

Data from ChEMBL 36 via Core Engine